ethyl 4-[2-(6-chloranylbenzotriazol-1-yl)oxyethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-(6-chloranylbenzotriazol-1-yl)oxyethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[(6-chloro-1-benzotriazolyl)oxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H17ClN4O4 MolecularWeight: 376.79428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CON2C3=C(C=CC(=C3)Cl)N=N2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CON2C3=C(C=CC(=C3)Cl)N=N2)C)C

InChI

InChI=1S/C17H17ClN4O4/c1-4-25-17(24)16-10(3)19-9(2)15(16)14(23)8-26-22-13-7-11(18)5-6-12(13)20-21-22/h5-7,19H,4,8H2,1-3H3